Skip to main content
Free research Free research Free compound review with research home and workspace preview
Quick search ChEMBL 36
Compound Detail

CHEMBL3309711

Enter ChEMBL ID:
Free Research Context This compound will appear in recent viewed items on the research home for this browser.
Research home View demo workspace
O=C(c1ccc2ccccc2n1)N1CCc2c([nH]c3ccccc23)C1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL3309711
Phase Preclinical
Structure Type MOL
InChI Key JOEIEPCXKQIXAL-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
3
Publications
0
Known Names

Molecular Properties

327.4
MW (Da)
3.91
ALogP
2
HBA
1
HBD
49.0
PSA (Ų)
0.58
QED
0
Ro5 Violations
1
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C21H17N3O
MW 327.39
Aromatic Rings 4
Heavy Atoms 25
NP-Likeness -1.05

Literature References

PubMed DOI Target Context # Activities
24980054 10.1016/j.bmcl.2014.06.030 Leishmania donovani 6
24980054 10.1016/j.bmcl.2014.06.030 Trypanosoma brucei 2
26560048 10.1016/j.ejmech.2015.10.049 Unchecked 1

Data from ChEMBL 36 via Core Engine